%chk=000291293.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291293

0 1
Br -0.647592 1.624537 2.020469
Br 4.429640 2.599097 1.625864
O -5.521612 0.660604 -1.391522
O -4.953748 2.894231 -0.819063
O -2.528973 -3.352554 -0.482356
O 6.431177 0.989310 -0.156368
N -0.879355 -1.870422 -0.019204
C 0.417580 -1.217904 -0.304792
C -1.687138 -1.305376 1.093317
C 1.536385 -1.795898 0.585651
C -2.494095 -0.115587 0.624886
C 2.818023 -1.043738 0.368173
C -3.634376 -0.401529 -0.180609
C -1.413035 -2.935066 -0.761285
C -4.379398 0.669005 -0.606334
C -2.175072 1.201870 0.943901
C -4.037308 2.015914 -0.262584
C -2.941557 2.313018 0.511226
C 2.998693 0.209412 0.977059
C 3.833661 -1.581336 -0.438780
C -0.576992 -3.520439 -1.861569
C -5.922471 2.062813 -1.543215
C 4.183815 0.916273 0.776239
C 5.020033 -0.877733 -0.645037
C 5.194513 0.372186 -0.033033
C 6.487768 2.025469 -1.172125
H 0.322808 -0.118920 -0.135045
H 0.682479 -1.334930 -1.378123
H -1.020566 -1.063485 1.950316
H -2.387476 -2.100190 1.468236
H 1.665385 -2.878146 0.385070
H 1.237344 -1.743492 1.654666
H -3.882700 -1.437641 -0.439483
H -2.679532 3.336623 0.775459
H 2.210542 0.624798 1.608970
H 3.699788 -2.556076 -0.907094
H -1.084283 -4.409526 -2.274680
H -0.439491 -2.817820 -2.694502
H 0.413285 -3.843550 -1.517798
H -5.855516 2.319308 -2.608666
H -6.900899 2.188424 -1.060674
H 5.822054 -1.285956 -1.259014
H 7.505339 2.413232 -1.038343
H 6.357504 1.577129 -2.160204
H 5.744572 2.804163 -0.980303


%chk=000291293-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291293

0 1
Br -0.923900 1.366242 2.561208
Br 4.332070 2.861528 1.341098
O -5.328287 0.888791 -1.688366
O -4.880268 3.040746 -0.722972
O -2.512767 -3.561353 -0.621021
O 6.453849 1.073923 -0.249391
N -0.912058 -1.970596 -0.054947
C 0.374269 -1.279459 -0.266855
C -1.787669 -1.460991 1.033089
C 1.494197 -1.748991 0.711061
C -2.551837 -0.202036 0.637571
C 2.798985 -1.008404 0.463803
C -3.580943 -0.342388 -0.349526
C -1.360078 -3.053265 -0.810930
C -4.297032 0.790398 -0.722183
C -2.313581 1.083207 1.182567
C -4.035911 2.058610 -0.156670
C -3.043730 2.243716 0.804877
C 2.952420 0.330832 0.909328
C 3.872285 -1.616671 -0.233851
C -0.425654 -3.601892 -1.887959
C -5.841735 2.278736 -1.571035
C 4.145267 1.034683 0.655925
C 5.063701 -0.906369 -0.487992
C 5.217811 0.430397 -0.049954
C 6.507578 1.988528 -1.410469
H 0.210984 -0.193155 -0.134712
H 0.712422 -1.423648 -1.306355
H -1.169574 -1.276512 1.927352
H -2.503295 -2.270639 1.257595
H 1.641683 -2.837961 0.588163
H 1.148307 -1.581875 1.748615
H -3.783847 -1.329594 -0.774830
H -2.840941 3.223337 1.240814
H 2.143665 0.817129 1.466416
H 3.779228 -2.655707 -0.571149
H -0.846474 -4.557532 -2.233308
H -0.371022 -2.915459 -2.753603
H 0.601366 -3.770943 -1.519597
H -5.874442 2.736123 -2.571484
H -6.825692 2.260544 -1.066963
H 5.906543 -1.372668 -1.008532
H 7.522922 2.411809 -1.400899
H 6.338303 1.429361 -2.351286
H 5.762085 2.799569 -1.314950


